Geometry & MOs

Info

ID:	30394
PubChem CID:	841247
Reduced:	NO2C18H21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	283.157229
ΔH_f, kcal/mol:	-61.2
Dipole, Da:	4.16
IP(EA), eV:	-9.01(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-3-methoxybenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)[C@@H](C)NC(=O)C2=CC(=CC=C2)OC)C

DOS

IR

Vibrations